2-[3-[(3-azanyl-4,4-dimethyl-6-oxidanyl-2,3-dihydro-1H-naphthalen-2-yl)sulfanyl]propanoylamino]-3-(4-hydroxyphenyl)propanamide

Systemtic Name: 2-[3-[(3-azanyl-4,4-dimethyl-6-oxidanyl-2,3-dihydro-1H-naphthalen-2-yl)sulfanyl]propanoylamino]-3-(4-hydroxyphenyl)propanamide Openeye Name: 2-[3-(3-amino-6-hydroxy-4,4-dimethyl-tetralin-2-yl)sulfanylpropanoylamino]-3-(4-hydroxyphenyl)propanamide CAS Name: 2-[[3-[(3-amino-6-hydroxy-4,4-dimethyl-2,3-dihydro-1H-naphthalen-2-yl)thio]-1-oxopropyl]amino]-3-(4-hydroxyphenyl)propanamide IUPAC Name: 2-[3-[(3-amino-6-hydroxy-4,4-dimethyl-2,3-dihydro-1H-naphthalen-2-yl)sulfanyl]propanoylamino]-3-(4-hydroxyphenyl)propanamide Traditional Name: 2-[3-[(3-amino-6-hydroxy-4,4-dimethyl-tetralin-2-yl)thio]propanoylamino]-3-(4-hydroxyphenyl)propionamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(CC2=C1C=C(C=C2)O)SCCC(=O)NC(CC3=CC=C(C=C3)O)C(=O)N)N)C

Isomeric SMILES

CC1(C(C(CC2=C1C=C(C=C2)O)SCCC(=O)NC(CC3=CC=C(C=C3)O)C(=O)N)N)C

InChI

InChI=1S/C24H31N3O4S/c1-24(2)18-13-17(29)8-5-15(18)12-20(22(24)25)32-10-9-21(30)27-19(23(26)31)11-14-3-6-16(28)7-4-14/h3-8,13,19-20,22,28-29H,9-12,25H2,1-2H3,(H2,26,31)(H,27,30)